# generated using pymatgen data_Nb12Ga5Pd3N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.03878037 _cell_length_b 7.03878026 _cell_length_c 7.03878011 _cell_angle_alpha 90.27692866 _cell_angle_beta 90.27692184 _cell_angle_gamma 90.27693073 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb12Ga5Pd3N4 _chemical_formula_sum 'Nb12 Ga5 Pd3 N4' _cell_volume 348.72007689 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Nb Nb0 1 0.78984829 0.95631536 0.37926581 1.0 Nb Nb1 1 0.70918368 0.04298131 0.87356939 1.0 Nb Nb2 1 0.21086038 0.45452421 0.12223135 1.0 Nb Nb3 1 0.29071902 0.54489840 0.62254231 1.0 Nb Nb4 1 0.95631536 0.37926581 0.78984829 1.0 Nb Nb5 1 0.04298131 0.87356939 0.70918368 1.0 Nb Nb6 1 0.45452421 0.12223135 0.21086038 1.0 Nb Nb7 1 0.54489840 0.62254231 0.29071902 1.0 Nb Nb8 1 0.37926581 0.78984829 0.95631536 1.0 Nb Nb9 1 0.87356939 0.70918368 0.04298131 1.0 Nb Nb10 1 0.12223135 0.21086038 0.45452421 1.0 Nb Nb11 1 0.62254231 0.29071902 0.54489840 1.0 Ga Ga12 1 0.67777750 0.67777750 0.67777750 1.0 Ga Ga13 1 0.57098160 0.42234999 0.93343847 1.0 Ga Ga14 1 0.42234999 0.93343847 0.57098160 1.0 Ga Ga15 1 0.93343847 0.57098160 0.42234999 1.0 Ga Ga16 1 0.07232231 0.07232231 0.07232231 1.0 Pd Pd17 1 0.17920464 0.82186327 0.31854443 1.0 Pd Pd18 1 0.31854443 0.17920464 0.82186327 1.0 Pd Pd19 1 0.82186327 0.31854443 0.17920464 1.0 N N20 1 0.87918472 0.12689315 0.62568781 1.0 N N21 1 0.62568781 0.87918472 0.12689315 1.0 N N22 1 0.12689315 0.62568781 0.87918472 1.0 N N23 1 0.37481260 0.37481260 0.37481260 1.0